Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS2R38 | P59533 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | PHGDH | O43175 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.46 |
| ▸ | CDK9 | P50750 | 1/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11679352 | 0.80 | SMN1; SMN2 (0.57) | HSD17B10NAPRTSMN1; SMN2TP53TSHR | |
| SCHEMBL11689139 | 0.80 | EPHX1 (0.58) | TAS2R38HSD17B10CYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL14044354 | 0.77 | ALDH1A1 (0.52) | SMN1; SMN2ALDH1A1GAAHTTNPC1 | |
| SCHEMBL21500298 | 0.77 | TAS2R38 (0.45) | TAS2R38HSD17B10NAPRTCYP1A2CYP2C19 | |
| SCHEMBL4789929 | 0.77 | ALDH1A1 (0.46) | TAS2R38HSD17B10CYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL10591421 | 0.76 | PHGDH (0.47) | TAS2R38HSD17B10NAPRTCYP1A2CYP2C19 | |
| SCHEMBL1687694 | 0.75 | TAS2R38 (0.58) | TAS2R38HSD17B10NAPRTCYP1A2CYP2C19 | |
| SCHEMBL2001630 | 0.74 | TAS2R38 (0.46) | TAS2R38HSD17B10NAPRTSMN1; SMN2ALDH1A1 | |
| SCHEMBL3067262 | 0.74 | SMN1; SMN2 (0.50) | HSD17B10NAPRTSMN1; SMN2ALDH1A1TP53 | |
| SCHEMBL3063972 | 0.74 | ALDH1A1 (0.50) | TAS2R38HSD17B10CYP1A2CYP2C19PHGDH |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109843322-A | The inhibitor and its application method of indole amine 2,3-dioxygenase | 百时美施贵宝公司 | 2019-06-04 | — | — | CN | disclosed |
| EP-0552352-A1 | PROCESS FOR THE PREPARATION OF HIGH MOLECULAR WEIGHT HALOGENATED POLYCARBONATE | THE DOW CHEMICAL COMPANY (US) | 1993-07-28 | — | — | EP | disclosed |
| WO-1993003083-A1 | PROCESS FOR THE PREPARATION OF HIGH MOLECULAR WEIGHT HALOGENATED POLYCARBONATE | THE DOW CHEMICAL COMPANY (US) | 1993-02-18 | — | — | WO | disclosed |